2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine

C19H33N — CID 106169105

IUPAC2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine
SMILESC1=C(CCNC2CCCCC2C2CCCCC2)CCC1
InChIInChI=1S/C19H33N/c1-2-10-17(11-3-1)18-12-6-7-13-19(18)20-15-14-16-8-4-5-9-16/h8,17-20H,1-7,9-15H2
InChIKeyJIDDUAQLOSEMFR-UHFFFAOYSA-N
MW275.48 g/mol
LogP5.22
Rot. Bonds5

About 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine

2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine (PubChem CID 106169105) has the molecular formula C19H33N and a molecular weight of 275.48 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine
PubChem CID106169105
Molecular FormulaC19H33N
Molecular Weight275.48 g/mol
Exact Mass275.26
IUPAC Name2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine
SMILESC1=C(CCNC2CCCCC2C2CCCCC2)CCC1
InChIInChI=1S/C19H33N/c1-2-10-17(11-3-1)18-12-6-7-13-19(18)20-15-14-16-8-4-5-9-16/h8,17-20H,1-7,9-15H2
InChIKeyJIDDUAQLOSEMFR-UHFFFAOYSA-N
XLogP5.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.48
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cyclopenten-1-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 106170204
N-[2-(cyclohexen-1-yl)ethyl]-2-methylcyclohexan-1-amine
CID 43078509
2-[2-(cyclohexen-1-yl)ethylamino]cyclopentan-1-ol
CID 60713815
N-[2-(cyclopenten-1-yl)ethyl]-1-azabicyclo[2.2.2]octan-3-amine
CID 106169922
cis-(1S,2R)-N-[2-(cyclohexen-1-yl)ethyl]-2-methylcyclopentan-1-amine
CID 97030527
N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine
CID 115895899
2-[2-(cyclopenten-1-yl)ethylamino]cyclobutane-1-carboxylic acid
CID 106178034
N-[2-(cyclohexen-1-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
CID 61308957
N-(cyclohexylmethyl)-2-(cyclopenten-1-yl)ethanamine
CID 115762872
N-[2-(cyclopenten-1-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 104844817
N'-(2-cyclohexylcyclohexyl)ethane-1,2-diamine
CID 60889120
N-but-3-enyl-2-cyclohexylcyclohexan-1-amine
CID 113465420

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine (CID 106169105) is 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine is C1=C(CCNC2CCCCC2C2CCCCC2)CCC1.
What is the InChIKey of 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine?
The InChIKey is JIDDUAQLOSEMFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N/c1-2-10-17(11-3-1)18-12-6-7-13-19(18)20-15-14-16-8-4-5-9-16/h8,17-20H,1-7,9-15H2.
What are the key properties of 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine?
2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine has a molecular weight of 275.48 g/mol, XLogP of 5.22, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 106169105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).